SCHEMBL5776650

SCHEMBL5776650

COCCNc1ccc2c(n1)CCN(Cc1ccccc1)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
HPGD P15428 1/20 0.48
MAPT P10636 5/20 0.47
TP53 P04637 3/20 0.47
C5AR1 P21730 1/20 0.47
FFAR1 O14842 1/20 0.45
DHFR P00374 1/20 0.45
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CHRM2 P08172 1/20 0.43
HTR1A P08908 1/20 0.43
CHRM3 P20309 1/20 0.43
DRD4 P21917 1/20 0.43
ADRA1D P25100 1/20 0.43
HTR2C P28335 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5777961 0.83 SIGMAR1 (0.51) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5771925 0.82 KMT2A (0.57) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL2910250 0.82 MEN1 (0.52) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL2910881 0.79 KMT2A (0.54) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL4766452 0.77 MEN1 (0.57) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5775010 0.77 MEN1 (0.52) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL5777641 0.77 NPC1 (0.49) MEN1KMT2ANPC1RAB9AHPGD
SCHEMBL28169874 0.77 RAB9A (0.54) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL12706737 0.76 MEN1 (0.61) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL10209789 0.75 NPC1 (0.52) MEN1KMT2ANPC1RAB9AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 MEN1 1661/4885KMT2A 3583/4885NPC1 468/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.